(E)-1-(azepan-1-yl)-3-(4-phenylmethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(azepan-1-yl)-3-(4-phenylmethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(4-benzyloxyphenyl)prop-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(4-phenylmethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(4-phenylmethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(4-benzoxyphenyl)prop-2-en-1-one Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C=CC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)/C=C/C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H25NO2/c24-22(23-16-6-1-2-7-17-23)15-12-19-10-13-21(14-11-19)25-18-20-8-4-3-5-9-20/h3-5,8-15H,1-2,6-7,16-18H2/b15-12+